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3-(4-methylphenyl)-2-Thiophenecarboxylic acid methyl ester
SpectraBase Compound ID 8qaAoir5HIa
InChI InChI=1S/C13H12O2S/c1-9-3-5-10(6-4-9)11-7-8-16-12(11)13(14)15-2/h3-8H,1-2H3
InChIKey OSWPMMUUONCFSU-UHFFFAOYSA-N
Mol Weight 232.3 g/mol
Molecular Formula C13H12O2S
Exact Mass 232.055801 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID l2uTcuv20b
Name 3-(4-methylphenyl)-2-Thiophenecarboxylic acid methyl ester
Appearance Colorless solid
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Formula C13H12O2S
InChI InChI=1S/C13H12O2S/c1-9-3-5-10(6-4-9)11-7-8-16-12(11)13(14)15-2/h3-8H,1-2H3
InChIKey OSWPMMUUONCFSU-UHFFFAOYSA-N
Instrument Name Agilent 5977B MSD
Ionization Type EI
Literature Reference DOI 10.1002/adsc.201900596
Molecular Weight 232.297 g/mol
Reported Formula C13H12O2S
SMILES c1c(-c2ccc(cc2)C)c(C(OC)=O)sc1
SPLASH splash10-0f89-0290000000-168151abcad948e94c9a
Source of Spectrum ASC-361-SM46-3ta
Wiley ID 1835368